[gmx-users] -dt option in g_velacc
Jinan Niu
njn0516 at 163.com
Mon Aug 8 10:28:30 CEST 2011
Hi, gmx users:
when I used g_velacc to calculate VAF, I found the minimum of dt could be taken to 0.1 ps, but smaller. If I want to gain more precise results, how can I do??
thanks!
--
Sincerely yours
Dr Ji-Nan Niu
School of Materials Science and Engineering.
China University of Mining and Technology.
Jiangsu Province, XuZhou 221116
P. R. China
_____________________________________________________
Email: njn0516 at cumt.edu.cn
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